N-(2-phenyl-1,3-benzoxazol-6-yl)but-2-ynamide
Chemical Structure Depiction of
N-(2-phenyl-1,3-benzoxazol-6-yl)but-2-ynamide
N-(2-phenyl-1,3-benzoxazol-6-yl)but-2-ynamide
Compound characteristics
| Compound ID: | T001-0357 |
| Compound Name: | N-(2-phenyl-1,3-benzoxazol-6-yl)but-2-ynamide |
| Molecular Weight: | 276.29 |
| Molecular Formula: | C17 H12 N2 O2 |
| Smiles: | CC#CC(Nc1ccc2c(c1)oc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8187 |
| logD: | 3.8187 |
| logSw: | -4.0464 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.198 |
| InChI Key: | ZLYXISJUJUEBDZ-UHFFFAOYSA-N |